1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea
TL;DR: 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea (CAS 13141-80-5) is a chemical compound with molecular formula C13H10FN3O3 and molecular weight 275.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(3-fluorophenyl)-3-(3-nitrophenyl)urea
Also Known As: 1-(3-fluorophenyl)-3-(3-nitrophenyl)urea, N-(3-fluorophenyl)-N'-(3-nitrophenyl)urea, 661-747-1, RefChem:224404
| Molecular Formula | C13H10FN3O3 |
|---|---|
| Molecular Weight | 275.07 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 87.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 275.07062 |
| Heavy Atoms | 20 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 13141-80-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)NC2=CC(=CC=C2)F |
| InChIKey | KCBTVNMPNIYQDF-UHFFFAOYSA-N |
Product Overview
1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea (CAS 13141-80-5), with molecular formula C13H10FN3O3 and molecular weight 275.07 g/mol. IUPAC: 1-(3-fluorophenyl)-3-(3-nitrophenyl)urea.
Chemical Property Profile of 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea
Property Insights of 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea
The XLogP value of 3.0 indicates that 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea. Following Lipinski's Rule of Five, 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea?
The CAS number of 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea is 13141-80-5.
What is the molecular formula of 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea?
The molecular formula of 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea is C13H10FN3O3.
What is the molecular weight of 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea?
The molecular weight of 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea is 275.07 g/mol.
Where can I buy 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea?
You can request a quote for 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea?
Yes, KEHONG BIO provides custom synthesis services for 1-(3-Fluorophenyl)-3-(3-nitrophenyl)urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.